2,2-dimethyl-3-(phenylmethyl)hexadecanal

Systemtic Name: 2,2-dimethyl-3-(phenylmethyl)hexadecanal Openeye Name: 3-benzyl-2,2-dimethyl-hexadecanal CAS Name: 2,2-dimethyl-3-(phenylmethyl)hexadecanal IUPAC Name: 3-benzyl-2,2-dimethylhexadecanal Traditional Name: 3-benzyl-2,2-dimethyl-palmitaldehyde Formula: C25H42O MolecularWeight: 358.60038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)C=O

Isomeric SMILES

CCCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)C=O

InChI

InChI=1S/C25H42O/c1-4-5-6-7-8-9-10-11-12-13-17-20-24(25(2,3)22-26)21-23-18-15-14-16-19-23/h14-16,18-19,22,24H,4-13,17,20-21H2,1-3H3